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Ligand

NameCHEMBL155877
Molecular formulaC28H27ClN8OS
IUPAC nameN-[4-[[3-butyl-5-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]methyl]phenyl]-2-(2H-tetrazol-5-yl)benzamide
Molecular weight559.089
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP5.8
SynonymsBDBM50047879
L004736
N-{4-[3-Butyl-5-(4-chloro-benzylsulfanyl)-[1,2,4]triazol-4-ylmethyl]-phenyl}-2-(1H-tetrazol-5-yl)-benzamide
SCHEMBL9402255
Inchi KeyAFNFXTCZKDGUEX-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H27ClN8OS/c1-2-3-8-25-31-34-28(39-18-20-9-13-21(29)14-10-20)37(25)17-19-11-15-22(16-12-19)30-27(38)24-7-5-4-6-23(24)26-32-35-36-33-26/h4-7,9-16H,2-3,8,17-18H2,1H3,(H,30,38)(H,32,33,35,36)
PubChem CID10053499
ChEMBLCHEMBL155877
IUPHARN/A
BindingDB50047879
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
4288Type-1 angiotensin II receptorP34976AGTR1Oryctolagus cuniculus (Rabbit)359

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